2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(2-cyanoethyl)ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(2-cyanoethyl)ethanamide Openeye Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(2-cyanoethyl)acetamide CAS Name: 2-[[2-(4-bromophenyl)-4-quinazolinyl]thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(2-cyanoethyl)acetamide Traditional Name: 2-[[2-(4-bromophenyl)quinazolin-4-yl]thio]-N-(2-cyanoethyl)acetamide Formula: C19H15BrN4OS MolecularWeight: 427.3176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Br)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Br)SCC(=O)NCCC#N

InChI

InChI=1S/C19H15BrN4OS/c20-14-8-6-13(7-9-14)18-23-16-5-2-1-4-15(16)19(24-18)26-12-17(25)22-11-3-10-21/h1-2,4-9H,3,11-12H2,(H,22,25)